Geometry & MOs

Info

ID:	376747
PubChem CID:	134222773
Reduced:	O2F8H22C23 (1)
Stoich.:	A2B8C22D23 (1)
Weight, g/mol:	502.119048
ΔH_f, kcal/mol:	-463.7
Dipole, Da:	8.89
IP(EA), eV:	-9.89(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]-1,3-difluoro-5-[4-(methoxymethyl)cyclohexyl]benzene

Drug info:

PubChemData

Smile

CCOCC1CCC(CC1)C2=CC(=C(C(=C2)F)C(OC3=CC(=C(C(=C3)F)C(F)F)F)(F)F)F

DOS

IR

Vibrations